CFam Chemical Families Database
BIDD Pharmainformatics Databases
 
   
You are searching for "CFAMM00246187" in compound.

Total 1 results found.

Click on CFAM IDs and names to search or view in CFAM, click on external IDs to view the entity in its source database.

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CFAM Mol ID CFAMM00246187
Family CFFID1684 Adenosine receptor A1 and Adenosine receptor A3 Ligand 2-(4-methoxyphenyl)-6-phenyl-9h-purine Family
Superfamily CFSCD144 Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform Inhibitor TG100-115 Superfamily
Class CFCCD118 Class 931
External ID CHEMBL1083801 External Source CHEMBL
PubChem CID 46866784 Functional Category Bioactive
Molecule Name SureCN209004
IUPAC Name 6-bromo-2-(4-methoxyphenyl)-7-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-1H-imidazo[4,5-b]pyridine
Synonyms AGN-PC-07ZZ81;CHEBI:731382;6-bromo-2-(4-methoxyphenyl)-7-[4-(pyridin-3-ylmethyl)piperazin-1-yl]-1H-imidazo[4,5-b]pyridine
InChi InChI=1S/C23H23BrN6O/c1-31-18-6-4-17(5-7-18)22-27-20-21(19(24)14-26-23(20)28-22)30-11-9-29(10-12-30)15-16-3-2-8-25-13-16/h2-8,13-14H,9-12,15H2,1H3,(H,26,27,28)
InChiKey DDKFQQFHOJBBBE-UHFFFAOYSA-N
Formula C23H23BrN6O Molecular Weight 479.37
Cross Link CHEMBL1083801
Structure

Statistics of CFAM Database

 
CFAM currently contains 490,279 molecules in 87,136 families, 34,880 superfamilies and 11,643 classes.
 

How to cite our database

 
C. Zhang, L. Tao, C. Qin, P. Zhang, S.Y. Chen, X. Zeng, F. Xu, Z. Chen, S.Y. Yang and Y.Z. CFam: A Chemical Families Database Based on Iterative Selection of Functional Seeds and Seed-Directed Compound Clustering. Nucl. Acids Res. 43 (D1): D558-D565 (2015) (First published online: November 20, 2014).
 

Last update by

 
2014.08.29
 

 

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Dr. Chen Yuzong

Deputy Director of Center for Computational Science and Engineering
Professor in Department of Pharmacy
National University of Singapore, Singapore


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